Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PTGIR | P43119 | 2/20 | 0.39 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2490876 | 0.86 | TRPM8 (0.51) | TRPM8CYP2C19NPSR1CNR2CES2 | |
| SCHEMBL2091758 | 0.84 | TRPM8 (0.56) | TRPM8CYP2C19NPSR1CNR2CES2 | |
| SCHEMBL8105552 | 0.84 | CYP2C19 (0.47) | TRPM8CYP2C19CNR2CES2CES1 | |
| SCHEMBL29268252 | 0.84 | CYP2C19 (0.47) | TRPM8CYP2C19CNR2CES2CES1 | |
| SCHEMBL2146885 | 0.84 | CYP2C19 (0.47) | TRPM8CYP2C19CNR2CES2CES1 | |
| SCHEMBL29009639 | 0.80 | CYP2C19 (0.43) | TRPM8CYP2C19NPSR1CNR2CES2 | |
| SCHEMBL7147096 | 0.80 | TSHR (0.48) | CYP2C19NPSR1CNR2CES2CES1 | |
| SCHEMBL5933542 | 0.78 | ALDH1A1 (0.48) | TRPM8CYP2C19NPSR1CES2CES1 | |
| SCHEMBL28335619 | 0.77 | NPSR1 (0.50) | TRPM8NPSR1ALDH1A1KMT2AMEN1 | |
| SCHEMBL2092543 | 0.77 | TRPM8 (0.51) | TRPM8NPSR1ALDH1A1KMT2AMEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2379476-A1 | NOVEL COMPOUNDS, DERIVATIVES THEREOF AND THEIR USE IN HETEROJUNCTION DEVICES | The University of Melbourne (AU) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010060160-A1 | NOVEL COMPOUNDS, DERIVATIVES THEREOF AND THEIR USE IN HETEROJUNCTION DEVICES | THE UNIVERSITY OF MELBOURNE (AU) | 2010-06-03 | — | — | WO | disclosed |